16,17-Dihydroxycyclooctatin (CHEBI:212594)

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CHEBI:212594 - 16,17-Dihydroxycyclooctatin

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ChEBI ID	CHEBI:212594
ChEBI Name	16,17-Dihydroxycyclooctatin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C20H34O5
Net Charge	0
Average Mass	354.487
Monoisotopic Mass	354.24062
SMILES	C[C@]12CC[C@H](C(CO)CO)C1=CC[C@](C)(O)[C@H]1[C@H](C2)[C@H](CO)C[C@H]1O
InChI	InChI=1S/C20H34O5/c1-19-5-3-14(13(10-22)11-23)16(19)4-6-20(2,25)18-15(8-19)12(9-21)7-17(18)24/h4,12-15,17-18,21-25H,3,5-11H2,1-2H3/t12-,14+,15+,17+,18-,19+,20-/m0/s1
InChIKey	IBYBZKFALRGWGZ-DDJVJDDHSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies LZ35 (ncbitaxon:1245024)	-	DOI (10.5582/ddt.2013.v7.5.185)

ChEBI Ontology

Outgoing Relation(s)
	16,17-Dihydroxycyclooctatin (CHEBI:212594) is a tertiary alcohol (CHEBI:26878)

IUPAC Name
(1R,3R,4R,6R,7S,8S,12R)-12-(1,3-dihydroxypropan-2-yl)-4-(hydroxymethyl)-1,8-dimethyltricyclo[9.3.0.03,7]tetradec-10-ene-6,8-diol